SCHEMBL2291580

SCHEMBL2291580

CC(C)(C)OC(=O)N1CC[C@@H](COc2ccc3ccccc3c2)C1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.50
SLC2A1 P11166 1/20 0.50
CHEK2 O96017 2/20 0.49
KDM4E B2RXH2 1/20 0.48
PKM P14618 1/20 0.48
YAP1 P46937 1/20 0.47
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
HTR3A P46098 1/20 0.46
KCNH2 Q12809 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2287874 1.00 GPR119 (0.50) GPR119SLC2A1CHEK2KDM4EPKM
SCHEMBL2287878 1.00 GPR119 (0.50) GPR119SLC2A1CHEK2KDM4EPKM
SCHEMBL13876978 0.87 KDM4E (0.56) GPR119SLC2A1KDM4EPKMYAP1
SCHEMBL30876501 0.85 SLC2A1 (0.53) GPR119SLC2A1CHEK2KDM4EPKM
SCHEMBL30876487 0.85 SLC2A1 (0.53) GPR119SLC2A1CHEK2KDM4EPKM
SCHEMBL22406147 0.85 SLC2A1 (0.53) GPR119SLC2A1CHEK2KDM4EPKM
SCHEMBL31298894 0.84 SCN9A (0.49) GPR119SLC2A1CHEK2KDM4EPKM
SCHEMBL19610292 0.84 GPR119 (0.54) GPR119SLC2A1CHEK2KDM4EPKM
SCHEMBL2227838 0.83 SLC6A2 (0.52) KDM4ESLC6A2SLC6A4HTR3AKCNH2
SCHEMBL2285047 0.83 SLC6A2 (0.52) KDM4ESLC6A2SLC6A4HTR3AKCNH2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011089550-A1 ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI AVENTIS (FR) 2011-07-28 WO disclosed